4-azanyl-2-[(4-chlorophenyl)amino]-N-phenyl-5-(phenylcarbonyl)-1H-pyrrole-3-carbothioamide

Systemtic Name: 4-azanyl-2-[(4-chlorophenyl)amino]-N-phenyl-5-(phenylcarbonyl)-1H-pyrrole-3-carbothioamide Openeye Name: 4-amino-5-benzoyl-2-(4-chloroanilino)-N-phenyl-1H-pyrrole-3-carbothioamide CAS Name: 4-amino-5-benzoyl-2-(4-chloroanilino)-N-phenyl-1H-pyrrole-3-carbothioamide IUPAC Name: 4-amino-5-benzoyl-2-(4-chloroanilino)-N-phenyl-1H-pyrrole-3-carbothioamide Traditional Name: 4-amino-5-benzoyl-2-(4-chloroanilino)-N-phenyl-1H-pyrrole-3-carbothioamide Formula: C24H19ClN4OS MolecularWeight: 446.95186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C(=C(N2)NC3=CC=C(C=C3)Cl)C(=S)NC4=CC=CC=C4)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C(=C(N2)NC3=CC=C(C=C3)Cl)C(=S)NC4=CC=CC=C4)N

InChI

InChI=1S/C24H19ClN4OS/c25-16-11-13-18(14-12-16)27-23-19(24(31)28-17-9-5-2-6-10-17)20(26)21(29-23)22(30)15-7-3-1-4-8-15/h1-14,27,29H,26H2,(H,28,31)